Nitroso-n-methyl-n-(2-phenylethyl)amine

Benzeneethanamine, N-methyl-N-nitroso-
Methylphenylethylnitrosamine
N-Methyl-N-nitrosobenzeneethanamine
N-Nitroso-N-methyl-2-phenylethylamine
Phenethylamine, N-methyl-N-nitroso-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	AVESHLVLHJKUKQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C9H12N2O/c1-11(10-12)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
IUPAC name chemrof:IUPAC_name	N-Methyl-N-nitrosobenzeneethanamine
Molecular formula chemrof:molecular_formula	C9H12N2O
Molecular mass chemrof:molecular_mass	164.208
Monoisotopic mass chemrof:monoisotopic_mass	164.094963
SMILES string chemrof:smiles_string	CN(CCc1ccccc1)N=O

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=13256-11-6	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.302.012	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID9021003	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL349620	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/DYK7894FDF	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J34.549K	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/83271	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q81983678	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
2906628e-6556-11dd-ad8b-0800200c9a66	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
fe0acd60-3ddc-11dd-adf0-0050c2490048	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
0b74e52e-259f-454a-bd5c-7f5f7581d792	Environmental → Air → Indoor	EF 3.1	kg	2
fe0acd60-3ddc-11dd-adef-0050c2490048	Environmental → Air → Long-term	EF 3.1	kg	0
fe0acd60-3ddc-11dd-adf1-0050c2490048	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
fe0acd60-3ddc-11dd-adee-0050c2490048	Environmental → Air → Unknown	EF 3.1	kg	2
fe0acd60-3ddc-11dd-adec-0050c2490048	Environmental → Ground → Agricultural	EF 3.1	kg	2
08a91e70-3ddc-11dd-9afe-0050c2490048	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
fe0acd60-3ddc-11dd-aded-0050c2490048	Environmental → Ground → Unknown	EF 3.1	kg	2
08a91e70-3ddc-11dd-9afc-0050c2490048	Environmental → Water → Long-term	EF 3.1	kg	0
08a91e70-3ddc-11dd-9aff-0050c2490048	Environmental → Water → Ocean	EF 3.1	kg	2
fe0acd60-3ddc-11dd-adf2-0050c2490048	Environmental → Water → Surface water	EF 3.1	kg	2
e9fb4bb972a6eb003954b76fe85e4e630df8799f	Environmental → Water → Unconfined aquifer	stepwise algorithm addition	kg	0
08a91e70-3ddc-11dd-9afd-0050c2490048	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

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Nitroso-n-methyl-n-(2-phenylethyl)amine

Identity

Structure

Alternative labels

Properties

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